methyl 2-[(cyanomethyl)sulfamoyl]benzoate
Chemical Structure Depiction of
methyl 2-[(cyanomethyl)sulfamoyl]benzoate
methyl 2-[(cyanomethyl)sulfamoyl]benzoate
Compound characteristics
| Compound ID: | 8012-5529 |
| Compound Name: | methyl 2-[(cyanomethyl)sulfamoyl]benzoate |
| Molecular Weight: | 254.26 |
| Molecular Formula: | C10 H10 N2 O4 S |
| Smiles: | COC(c1ccccc1S(NCC#N)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6051 |
| logD: | 0.6049 |
| logSw: | -2.3195 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.775 |
| InChI Key: | KKAJWYKXGCOBCO-UHFFFAOYSA-N |